Methyl 4-amino-5-chloro-2-methoxybenzoate
TL;DR: Methyl 4-amino-5-chloro-2-methoxybenzoate (CAS 2750281-39-9) is a chemical compound with molecular formula C9H10ClNO3 and molecular weight 215.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-amino-5-chloro-2-methoxybenzoate
Also Known As: methyl 4-amino-5-chloro-2-methoxybenzoate, Metoclopramide Impurity 28, Metoclopramide Impurity 10, 4-Amino-5-chloro-o-anisic Acid Methyl Ester, Benzoic acid, 4-amino-5-chloro-2-methoxy-, methyl ester
| Molecular Formula | C9H10ClNO3 |
|---|---|
| Molecular Weight | 215.03 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 61.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 215.03493 |
| Heavy Atoms | 14 |
| Complexity | 212.0 |
Chemical Identifiers
| CAS Number | 2750281-39-9 |
|---|---|
| SMILES | COC1=CC(=C(C=C1C(=O)OC)Cl)N |
| InChIKey | ALYQFGBPEGLBLW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyl 4-amino-5-chloro-2-methoxybenzoate (CAS 2750281-39-9), with molecular formula C9H10ClNO3 and molecular weight 215.03 g/mol. IUPAC: methyl 4-amino-5-chloro-2-methoxybenzoate.
Chemical Property Profile of Methyl 4-amino-5-chloro-2-methoxybenzoate
Property Insights of Methyl 4-amino-5-chloro-2-methoxybenzoate
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 4-amino-5-chloro-2-methoxybenzoate. The TPSA of 61.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 4-amino-5-chloro-2-methoxybenzoate. Following Lipinski's Rule of Five, Methyl 4-amino-5-chloro-2-methoxybenzoate has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Methyl 4-amino-5-chloro-2-methoxybenzoate?
The CAS number of Methyl 4-amino-5-chloro-2-methoxybenzoate is 2750281-39-9.
What is the molecular formula of Methyl 4-amino-5-chloro-2-methoxybenzoate?
The molecular formula of Methyl 4-amino-5-chloro-2-methoxybenzoate is C9H10ClNO3.
What is the molecular weight of Methyl 4-amino-5-chloro-2-methoxybenzoate?
The molecular weight of Methyl 4-amino-5-chloro-2-methoxybenzoate is 215.03 g/mol.
Where can I buy Methyl 4-amino-5-chloro-2-methoxybenzoate?
You can request a quote for Methyl 4-amino-5-chloro-2-methoxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4-amino-5-chloro-2-methoxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-amino-5-chloro-2-methoxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.